264288

Source:http://linkedlifedata.com/resource/chembl/compound/264288

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:standardIn...	InChI=1S/C11H19NO4S/c1-8(7-17)11(15)12(6-10(13)14)5-9-3-2-4-16-9/h8-9,17H,2-7H2,1H3,(H,13,14)
chemicalCompound:standardIn...	IRTCUELFDCFLIK-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(CS)C(=O)N(CC1CCCO1)CC(=O)O
chemicalCompound:molecularF...	C11 H19 N O4 S
chemicalCompound:moleculeId	264288
chemicalCompound:mwFreebase	261.338
chemicalCompound:alogp	0.429
chemicalCompound:hba	5
chemicalCompound:hbd	2
chemicalCompound:psa	105.64
chemicalCompound:rtb	6
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	3.437
chemicalCompound:acdLogP	1.142
chemicalCompound:acdLogD	-2.492
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	261.338
chemicalCompound:chemblId	CHEMBL347633
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:364288
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:activity	activity:705162